7-[2-[(E)-4-methyl-3-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-[(E)-4-methyl-3-oxidanyl-oct-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[3-hydroxy-2-[(E)-3-hydroxy-4-methyl-oct-1-enyl]-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[3-hydroxy-2-[(E)-3-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[3-hydroxy-2-[(E)-3-hydroxy-4-methyloct-1-enyl]-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[3-hydroxy-2-[(E)-3-hydroxy-4-methyl-oct-1-enyl]-5-keto-cyclopentyl]enanthic acid Formula: C21H36O5 MolecularWeight: 368.50754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(C=CC1C(CC(=O)C1CCCCCCC(=O)O)O)O

Isomeric SMILES

CCCCC(C)C(/C=C/C1C(CC(=O)C1CCCCCCC(=O)O)O)O

InChI

InChI=1S/C21H36O5/c1-3-4-9-15(2)18(22)13-12-17-16(19(23)14-20(17)24)10-7-5-6-8-11-21(25)26/h12-13,15-18,20,22,24H,3-11,14H2,1-2H3,(H,25,26)/b13-12+